(Q104994509)

English

(22E)-6alpha-Hydroxystigmasta-4,22-diene-3-one

chemical compound

In more languages

Statements

type of chemical entity

0 references

17-(5-Ethyl-6-methylhept-3-en-2-yl)-6-hydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one

1 reference

based on heuristic

inferred from SMILES

426.349780712 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1R,3aS,3bS,5R,9aR,9bS,11aR)-1-[(2R,3E,5S)-5-ethyl-6-methylhept-3-en-2-yl]-5-hydroxy-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,5H,8H,9H,9bH,10H,11H-cyclopenta[a]phenanthren-7-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₉H₄₆O₂

0 references

canonical SMILES

O=C1C=C2C(O)CC3C(CCC4(C)C(CCC34)C(C=CC(CC)C(C)C)C)C2(C)CC1

0 references

isomeric SMILES

CC[C@H](/C=C/[C@@H](C)[C@H]1CC[C@H]2[C@@H]3C[C@H](O)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C)C(C)C

0 references

Bauhinia purpurea

1 reference

Studies on the Constituents from the Bark ofBauhinia Purpurea

1 reference

Bioactive steroids from Oryza sativa L.

Identifiers

InChI=1S/C29H46O2/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-22-17-27(31)26-16-21(30)12-14-29(26,6)25(22)13-15-28(23,24)5/h8-9,16,18-20,22-25,27,31H,7,10-15,17H2,1-6H3/b9-8+/t19-,20-,22+,23-,24+,25+,27+,28-,29-/m1/s1

0 references

FFKIQLXJMQUBQZ-PCZQUQHRSA-N

0 references

1 reference

17 September 2022

based on heuristic

inferred from InChIKey

UniChem compound ID

1 reference

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