[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] N-[1-[2-[[1,5-bis[2-[bis(azanyl)methylideneamino]ethylamino]-1,5-bis(oxidanylidene)pentan-2-yl]amino]ethylimino]-3-phenyl-propan-2-yl]carbamate

Systemtic Name: [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] N-[1-[2-[[1,5-bis[2-[bis(azanyl)methylideneamino]ethylamino]-1,5-bis(oxidanylidene)pentan-2-yl]amino]ethylimino]-3-phenyl-propan-2-yl]carbamate Openeye Name: [17-(1,5-dimethylhexyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] N-[1-benzyl-2-[2-[[4-(2-guanidinoethylamino)-1-(2-guanidinoethylcarbamoyl)-4-oxo-butyl]amino]ethylimino]ethyl]carbamate CAS Name: N-[1-[2-[[1,5-bis[2-(diaminomethylideneamino)ethylamino]-1,5-dioxopentan-2-yl]amino]ethylimino]-3-phenylpropan-2-yl]carbamic acid [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ester IUPAC Name: [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] N-[1-[2-[[1,5-bis[2-(diaminomethylideneamino)ethylamino]-1,5-dioxopentan-2-yl]amino]ethylimino]-3-phenylpropan-2-yl]carbamate Traditional Name: N-[1-benzyl-2-[2-[[4-(2-guanidinoethylamino)-1-(2-guanidinoethylcarbamoyl)-4-keto-butyl]amino]ethylimino]ethyl]carbamic acid [17-(1,5-dimethylhexyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ester Formula: C50H83N11O4 MolecularWeight: 902.26532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)NC(CC5=CC=CC=C5)C=NCCNC(CCC(=O)NCCN=C(N)N)C(=O)NCCN=C(N)N)C)C

Isomeric SMILES

CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)NC(CC5=CC=CC=C5)C=NCCNC(CCC(=O)NCCN=C(N)N)C(=O)NCCN=C(N)N)C)C

InChI

InChI=1S/C50H83N11O4/c1-33(2)10-9-11-34(3)40-16-17-41-39-15-14-36-31-38(20-22-49(36,4)42(39)21-23-50(40,41)5)65-48(64)61-37(30-35-12-7-6-8-13-35)32-55-24-25-56-43(45(63)58-27-29-60-47(53)54)18-19-44(62)57-26-28-59-46(51)52/h6-8,12-14,32-34,37-43,56H,9-11,15-31H2,1-5H3,(H,57,62)(H,58,63)(H,61,64)(H4,51,52,59)(H4,53,54,60)