(Q27138609)

cabraleahydroxylactone (English)

(5S)-5-[(3R,5R,8R,9R,10R,13S,14R,17R)-3-hydroxy-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-5-methyloxolan-2-one

7 October 2016

stereoisomer of

1 reference

based on heuristic

inferred from InChI

(5S)-5-[(1S,3aR,3bR,5aR,7S,9aR,9bR,11aR)-7-hydroxy-3a,3b,6,6,9a-pentamethyl-dodecahydro-1H-cyclopenta[a]phenanthren-1-yl]-5-methyloxolan-2-one

1 reference

based on heuristic

inferred from InChI

(5S)-5-[(3S,5R,8R,9R,10R,13S,14R,17R)-3-hydroxy-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-5-methyloxolan-2-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₇H₄₄O₃

1 reference

cabraleahydroxylactone (English)

7 October 2016

canonical SMILES

CC1(C2CCC3(C(C2(CCC1O)C)CCC4C3(CCC4C5(CCC(=O)O5)C)C)C)C

1 reference

cabraleahydroxylactone (English)

7 October 2016

isomeric SMILES

C[C@@]12CC[C@@H]([C@H]1CC[C@H]3[C@]2(CC[C@@H]4[C@@]3(CC[C@H](C4(C)C)O)C)C)[C@@]5(CCC(=O)O5)C

1 reference

Bioactive flavaglines and other constituents isolated from Aglaia perviridis

cabraleahydroxylactone (English)

7 October 2016

1 reference

Aglaia abbreviata

1 reference

Triterpenoids from Aglaia abbreviata and their cytotoxic activities.

Aglaia erythrosperma

1 reference

Biologically active constituents of Aglaia erythrosperma

Aglaia lawii

1 reference

Dammarane Triterpenoids from Amoora yunnanensis

Dysoxylum binectariferum

1 reference

Cytotoxic dammarane-type triterpenoids from the stem bark of Dysoxylum binecteriferum.

Dysoxylum ficiforme

1 reference

Cytotoxic dammarane-type triterpenoids from the stem bark of Dysoxylum binecteriferum.

Dysoxylum gotadhora

1 reference

Cytotoxic dammarane-type triterpenoids from the stem bark of Dysoxylum binecteriferum.

Camellia japonica

1 reference

Triterpene alcohols from camellia and sasanqua oils and their anti-inflammatory effects

Betula platyphylla var. japonica

1 reference

Triterpenoids from the floral spikes of Betula platyphylla var. japonica and their reversing activity against multidrug-resistant cancer cells

Aglaia elaeagnoidea

1 reference

Triterpenoids from Aglaia abbreviata and their cytotoxic activities.

Identifiers

InChI

InChI=1S/C27H44O3/c1-23(2)19-10-15-26(5)20(24(19,3)13-11-21(23)28)8-7-17-18(9-14-25(17,26)4)27(6)16-12-22(29)30-27/h17-21,28H,7-16H2,1-6H3/t17-,18+,19+,20-,21-,24+,25-,26-,27+/m1/s1

1 reference

cabraleahydroxylactone (English)

AHDUWGQSZYSNEY-HUOCPXEISA-N

7 October 2016

InChIKey

2 references

cabraleahydroxylactone (English)

7 October 2016

ChEBI release 2020-09-01

CAS Registry Number

35833-69-3

1 reference

CAS (formerly Chemical Abstracts Service)

25 January 2022

1 reference

(3alpha,5alpha)-3-Hydroxy-4,4,8,14-tetramethyl-20,24-epoxy-18-norcholan-24-one (English)

7 October 2016

2 references

cabraleahydroxylactone (English)

matched by identifier from

7 October 2016

InChIKey

AHDUWGQSZYSNEY-HUOCPXEISA-N

Reaxys registry number

1628323

1 reference

cabraleahydroxylactone (English)

7 October 2016

ChEBI ID

70269

mapping relation type

2 references

cabraleahydroxylactone (English)

matched by identifier from

7 October 2016

International Chemical Identifier

InChI

InChI=1S/C27H44O3/c1-23(2)19-10-15-26(5)20(24(19,3)13-11-21(23)28)8-7-17-18(9-14-25(17,26)4)27(6)16-12-22(29)30-27/h17-21,28H,7-16H2,1-6H3/t17-,18+,19+,20-,21-,24+,25-,26-,27+/m1/s1

1 reference