Ergosterol D (Q27138658)

CHEBI:70316 (English)

(3S,5R,10S,13R,14R,17R)-17-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,5,6,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol

7 October 2016

stereoisomer of

2 references

inferred from InChIKey

(3S,5S,10S,13R,14R,17R)-17-[(E,2S,5R)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,5,6,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol

1 reference

(3S,5S,10S,13R,14S,17R)-17-[(E,2S,5R)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,5,6,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol

1 reference

(3S,5R,10S,13R,14R,17R)-17-[(2R,5R)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,5,6,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol

1 reference

chemical formula

C₂₈H₄₄O

1 reference

CHEBI:70316 (English)

7 October 2016

canonical SMILES

CC(C)C(C)C=CC(C)C1CCC2C1(CC=C3C2=CCC4C3(CCC(C4)O)C)C

1 reference

CHEBI:70316 (English)

7 October 2016

isomeric SMILES

C[C@H](/C=C/[C@H](C)C(C)C)[C@H]1CC[C@@H]2[C@@]1(CC=C3C2=CC[C@@H]4[C@@]3(CC[C@@H](C4)O)C)C

1 reference

CHEBI:70316 (English)

Taiwanofungus camphoratus

7 October 2016

found in taxon

1 reference

stated in

Camphoratins A-J, potent cytotoxic and anti-inflammatory triterpenoids from the fruiting body of Taiwanofungus camphoratus

Identifiers

InChI

InChI=1S/C28H44O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-8,10,14,18-22,24-25,29H,9,11-13,15-17H2,1-6H3/b8-7+/t19-,20+,21-,22-,24+,25-,27-,28+/m0/s1

1 reference

CHEBI:70316 (English)

XSMGJKKUFBTARU-MJXYXNKESA-N

7 October 2016

InChIKey

2 references

CHEBI:70316 (English)

7 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(3beta,5alpha,22E)-Ergosta-7,9(11),22-trien-3-ol (English)

7 October 2016

2 references

CHEBI:70316 (English)

matched by identifier from

7 October 2016

InChIKey

XSMGJKKUFBTARU-MJXYXNKESA-N

ChEBI ID

70316

mapping relation type

2 references

Ergosterol D (English)

matched by identifier from

7 October 2016

International Chemical Identifier

InChI

InChI=1S/C28H44O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-8,10,14,18-22,24-25,29H,9,11-13,15-17H2,1-6H3/b8-7+/t19-,20+,21-,22-,24+,25-,27-,28+/m0/s1

1 reference

1 reference

http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download

XSMGJKKUFBTARU-MJXYXNKESA-N

31 December 2022

InChIKey