2-[(4R)-4-[(3S,5R,8R,9S,10S,13R,14S,17R)-3-azanyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentyl]guanidine

Systemtic Name: 2-[(4R)-4-[(3S,5R,8R,9S,10S,13R,14S,17R)-3-azanyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentyl]guanidine Openeye Name: 2-[(4R)-4-[(3S,5R,8R,9S,10S,13R,14S,17R)-3-amino-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentyl]guanidine CAS Name: 2-[(4R)-4-[(3S,5R,8R,9S,10S,13R,14S,17R)-3-amino-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentyl]guanidine IUPAC Name: 2-[(4R)-4-[(3S,5R,8R,9S,10S,13R,14S,17R)-3-amino-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentyl]guanidine Traditional Name: 2-[(4R)-4-[(3S,5R,8R,9S,10S,13R,14S,17R)-3-amino-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentyl]guanidine Formula: C25H46N4 MolecularWeight: 402.65954

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCN=C(N)N)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)N)C)C

Isomeric SMILES

C[C@H](CCCN=C(N)N)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@@H](C4)N)C)C

InChI

InChI=1S/C25H46N4/c1-16(5-4-14-29-23(27)28)20-8-9-21-19-7-6-17-15-18(26)10-12-24(17,2)22(19)11-13-25(20,21)3/h16-22H,4-15,26H2,1-3H3,(H4,27,28,29)/t16-,17-,18+,19+,20-,21+,22+,24+,25-/m1/s1