Terminology Service for NFDI4Health
JSON

hopane-6beta,7beta,22-triol

Go to external page http://purl.obolibrary.org/obo/CHEBI_67965

A hopanoid that is hopane substituted by hydroxy groups at positions 6, 7 and 22 (the 6beta,7beta-stereoisomer). It has been isolated from Conoideocrella tenuis.

Term info

Label

hopane-6beta,7beta,22-triol

Synonyms
  • (6beta,7beta)-hopane-6,7,22-triol
database cross reference
Subsets

3_STAR

IUPAC NAME
(6beta,7beta)-hopane-6,7,22-triol [ IUPAC ]

charge

0

formula

C30H52O3

has obo namespace

chebi_ontology

id

CHEBI:67965

inchi

InChI=1S/C30H52O3/c1-25(2)14-9-15-28(6)21-11-10-20-27(5)16-12-18(26(3,4)33)19(27)13-17-29(20,7)30(21,8)24(32)22(31)23(25)28/h18-24,31-33H,9-17H2,1-8H3/t18-,19-,20+,21+,22-,23-,24-,27-,28+,29+,30-/m0/s1

inchikey

VYLJAYXZTOTZRR-QKJSLZMYSA-N

mass

460.73210

monoisotopicmass

460.39165

smiles

CC(C)(O)[C@H]1CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2CC[C@@H]2[C@@]3(C)CCCC(C)(C)[C@@H]3[C@H](O)[C@H](O)[C@@]12C