(Q27138607)

Cabralealactone (English)

(5S)-5-methyl-5-[(5R,8R,9S,10R,13R,14R,17S)-4,4,8,10,14-pentamethyl-3-oxo-1,2,5,6,7,9,11,12,13,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]oxolan-2-one

7 October 2016

stereoisomer of

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(5R)-5-methyl-5-[(5R,8R,9R,10R,13R,14R,17S)-4,4,8,10,14-pentamethyl-3-oxo-1,2,5,6,7,9,11,12,13,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]oxolan-2-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₇H₄₂O₃

1 reference

Cabralealactone (English)

7 October 2016

canonical SMILES

CC1(C2CCC3(C(C2(CCC1=O)C)CCC4C3(CCC4C5(CCC(=O)O5)C)C)C)C

1 reference

Cabralealactone (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(CCC(=O)C4(C)C)C)C)[C@@]5(CCC(=O)O5)C

1 reference

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

Cabralealactone (English)

7 October 2016

1 reference

Aglaia leucophylla

1 reference

Secotirucallane triterpenes from the stem bark of Aglaia leucophylla

Aglaia tomentosa

1 reference

Dammarane triterpenes and pregnane steroids from Aglaia lawii and A. tomentosa

Cleome africana

2 references

Cleome amblyocarpa

2 references

Dysoxylum cauliflorum

1 reference

A triterpenoid with a novel abeo-dammarane skeleton from Dysoxylum cauliflorum

Aglaia abbreviata

1 reference

Triterpenoids from Aglaia abbreviata and their cytotoxic activities.

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.

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/C27H42O3/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/h17-20H,7-16H2,1-6H3/t17-,18+,19+,20-,24+,25-,26-,27+/m1/s1

1 reference

Cabralealactone (English)

NOLGXQBEFHYZHI-QPBHWVAKSA-N

7 October 2016

InChIKey

2 references

Cabralealactone (English)

7 October 2016

ChEBI release 2020-09-01

CAS Registry Number

19865-87-3

1 reference

CAS (formerly Chemical Abstracts Service)

25 January 2022

1 reference

(5alpha)-4,4,8,14-Tetramethyl-20,24-epoxy-18-norcholane-3,24-dione (English)

7 October 2016

2 references

Cabralealactone (English)

matched by identifier from

7 October 2016

InChIKey

NOLGXQBEFHYZHI-QPBHWVAKSA-N

Reaxys registry number

95091

1 reference

cabralealactone (English)

7 October 2016

ChEBI ID

70268

mapping relation type

2 references

cabralealactone (English)

matched by identifier from

7 October 2016

International Chemical Identifier

InChI

InChI=1S/C27H42O3/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/h17-20H,7-16H2,1-6H3/t17-,18+,19+,20-,24+,25-,26-,27+/m1/s1

1 reference