UCSF

ZINC02539827

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 17 Yes

Other Names:

(-)-(6R)-2-Amino-6-((1R,2S)-1,2-dihydroxypropyl)-5,6,7,8-tetrahydro-4(3H)-pteridinone

(1R,2S)-(2-Amino-3,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)-1,2-propandiol

(1R,2S)-(2-Amino-3,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)-1,2-propandiol; 2-Amino-6-(1,2-dihydroxypropyl)-5,6,7,8-tetrahydoro-4(1H)-5,6,7,8-Tetrahydro-2-amino-6-(1,2-dihydroxypropyl)-4(1H)-pteridinone; 2-Amino-6-(1,2-dihydroxypropyl)-5,6,7,8-tetrahydro-4

(1R,2S)-(2-Amino-3,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)-1,2-propandiol; 4(1H)-Pteridinone, 5,6,7,8-tetrahydro-2-amino-6-(1,2-dihydroxypropyl)-; 5,6,7,8-Tetrahydro-2-amino-6-(1,2-dihydroxypropyl)-4(1H)-pteridinone; 5,6,7,8-Tetrahydrobiopterin; 5,6,7,8-e

(1R,2S)-(2-Amino-3,4,5,6,7,8-hexahydro-4-oxo-6-pteridinyl)-1,2-propandiol;2-Amino-6-(1,2-dihydroxypropyl)-5,6,7,8-tetrahydoro-4(1H)-5,6,7,8-Tetrahydro-2-amino-6-(1,2-dihydroxypropyl)-4(1H)-pteridinone;2-Amino-6-(1,2-dihydroxypropyl)-5,6,7,8-tetrahydro-4(1

(6R)-2-Amino-6-((1R,2S)-1,2-dihydroxypropyl)-5,6,7,8-tetrahydro-4(1H)-pteridinone dihydrochloride; (6R)-Tetrahydrobiopterin hydrochloride; 4(1H)-Pteridinone, 5,6,7,8-tetrahydro-2-amino-6-(1,2-dihydroxypropyl)-, dihydrochloride, (6R-(6R*(1R*,2S*)))-; LS-12

(6R)-2-amino-6-[(1R,2S)-1,2-dihydroxypropyl]-5,6,7,8-tetrahydro-1H-pteridin-4-one

(6R)-2-amino-6-[(1R,2S)-1,2-dihydroxypropyl]-5,6,7,8-tetrahydropteridin-4(1H)-one

(6R)-2-amino-6-[(1R,2S)-1,2-dihydroxypropyl]-5,6,7,8-tetrahydropteridin-4(3H)-one

(6R)-5,6,7,8-Tetrahydro-L-biopterin; (6R)-5,6,7,8-Tetrahydrobiopterin; (6R)-L-erythro-5,6,7,8-Tetrahydrobiopterin; (6R)-L-erythro-Tetrahydrobiopterin; (6R)-Tetrahydrobiopterin; 6R-BH4; 6R-Tetrahydro-L-biopterin; 6b-5,6,7,8-Tetrahydro-L-biopterin; R-THBP

(6R)-5,6,7,8-Tetrahydro-L-biopterin;(6R)-5,6,7,8-Tetrahydrobiopterin;(6R)-L-erythro-5,6,7,8-Tetrahydrobiopterin;(6R)-L-erythro-Tetrahydrobiopterin;(6R)-Tetrahydrobiopterin;6b-5,6,7,8-Tetrahydro-L-biopterin;6R-BH4;6R-Tetrahydro-L-biopterin;R-THBP;Sapropter

(6R)-5,6,7,8-Tetrahydro-L-biopterin;(6R)-5,6,7,8-Tetrahydrobiopterin;(6R)-L-erythro-5,6,7,8-Tetrahydrobiopterin;(6R)-L-erythro-Tetrahydrobiopterin;(6R)-Tetrahydrobiopterin;6R-BH4;6R-Tetrahydro-L-biopterin;6b-5,6,7,8-Tetrahydro-L-biopterin;R-THBP;Sapropter

(6R)-L-erythro-tetrahydrobiopterin

(6R)-Tetrahydro-L-biopterinSulfate

(6R,1'R,2'S)-5,6,7,8 TETRAHYDROBIOPTERIN

(R)-2-Amino-6-((1R,2S)-1,2-dihydroxypropyl)-5,6,7,8-tetrahydropteridin-4(3H)-onedihydrochloride

17528-72-2

17528-72-2; 5,6,7,8-erythro-tetrahydrobiopterin; 5,6,7,8-tetra-H-biopterin; 5,6,7,8-tetrahydrobiopterin; phenylalanine hydroxylase cofactor; tetra-H-biopterin; tetra-hydro-biopterin; tetrahydrobiopterin

2-Amino-6-(1,2-dihydroxypropyl)-5,6,7,8-tetrahydoro-4(1H)-pteridinone

2-amino-6-(1,2-dihydroxypropyl)-5,6,7,8-tetrahydro-1H-pteridin-4-one

2-amino-6-(1,2-dihydroxypropyl)-5,6,7,8-tetrahydropteridin-4(3H)-one

2-amino-6-[(1R,2S)-1,2-dihydroxypropyl]-5,6,7,8-tetrahydro-1H-pteridin-4-one

27070-47-9

4(1H)-Pteridinone, 5,6,7,8-tetrahydro-2-amino-6-(1,2-dihydroxypropyl)-

5,6,7,8 Tetrahydrobiopterin

5,6,7,8-erythro-tetrahydrobiopterin

5,6,7,8-tetra-H-biopterin

5,6,7,8-Tetrahydro-2-amino-6-(1,2-dihydroxypropyl)-4(1H)-pteridinone

5,6,7,8-tetrahydro-L-erythrobiopterin

5,6,7,8-tetrahydrobiopterin

5,6,7,8-tetrahydrobiopterin; BH4

5,6,7,8-tetrahydrodictyopterin

5-26-18-00418 (Beilstein Handbook Reference)

62989-33-7

69081654-1FB6-4B89-B9B9-823C9887EE36

6R-5,6,7,8-Tetrahydrobiopterin

6R-BH4

6R-L-5,6,7,8-Tetrahydrobiopterin

6R-L-erythro-5,6,7,8-tetrahydrobiopterin

7-tetrahydrobiopterin

AC1L1AS5

AC1L2BG0

AC1Q6INE

AC1Q6ING

AR-1H3940

BCBcMAP01_000204

BH4

Biopterin, 5,6,7,8-tetrahydro-

BPH4

BRN 0544742

C00272

C9H15N5O3

CHEBI:15372

CHEBI:43063; CHEBI:15219; CHEBI:26902; CHEBI:9480; CHEBI:12074

CHEBI:59560

CHEMBL1201774

CID1125

CID44257

CID9816201

D08505

DAP000538

Dapropterin

DB00360

DNC000311

Kuvan

L-erythro-2-Amino-6-(1,2-dihydroxypropyl)-5,6,7,8-tetrahydro-4(3H)-pteridinon

L-erythro-5,6,7,8-tetrahydrobiopterin

L-erythro-5,6,7,8-tetrahydrobiopterin; L-erythro-tetrahydrobiopterin

LS-126327

MFCD12828857

MolPort-004-964-609

Phenoptin

phenylalanine hydroxylase cofactor

R-THBP

Sapropterin

Sapropterin (INN)

Sapropterin [INN]

Sapropterina

Sapropterina [INN-Spanish]

Sapropterinum

Sapropterinum [INN-Latin]

SMP1_000285

tetra-H-biopterin

tetra-hydro-biopterin

tetrahydro-6-biopterin

tetrahydro-L-Biopterin (dihydrochloride)

tetrahydro-L-Biopterin (hydrochloride)

THB

UNII-EGX657432I

ZINC00057518

ZINC04475363

ZINC13585233

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -1.15 -5.25 -21.45 7 8 0 136 241.251 2

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 2.21e+00 g/l DrugBank-approved
UniProt Database Links ALKMO_DANRE; ALKMO_HUMAN; ALKMO_MOUSE; ALKMO_RAT; ALKMO_XENTR; CED9_CAEBR; CED9_CAEEL; DHPR_BOVIN; DHPR_DICDI; DHPR_HUMAN; DHPR_MOUSE; DHPR_PIG; DHPR_RAT; DYR_HUMAN; EGLN3_HUMAN; EGLN3_MOUSE; EGLN3_RAT; FKBP8_HUMAN; FKBP8_MOUSE; FKBP8_RAT; GCH1_CHICK; GCH ChEBI
Reactome Database Links REACT_111041; REACT_111060; REACT_111062; REACT_111093; REACT_111106; REACT_111125; REACT_111175; REACT_111191; REACT_111249; REACT_12415; REACT_12443; REACT_12463; REACT_12488; REACT_15352; REACT_15366; REACT_1925; REACT_2 ChEBI

Activity (Go SEA)

Direct Reactome Annotations (via ChEBI)

Description Species
Abnormal metabolism in phenylketonuria
Catecholamine biosynthesis
eNOS activation
NOSIP mediated eNOS trafficking
NOSTRIN mediated eNOS trafficking
Phenylalanine and tyrosine catabolism
Serotonin and melatonin biosynthesis
Tetrahydrobiopterin (BH4) synthesis, recycling, salvage and regulation
VEGFR2 mediated vascular permeability

Analogs ( Draw Identity 99% 90% 80% 70% )