化学式

CAS号

IUPAC Name

(4S,4aS,5aR,12aS)-4-[氯(甲基)氨基]-3,10,12,12a-四羟基-11-亚甲基-1-氧代-3,4,4a,5,5a,6-六氢-2H-并四苯-2-甲腈 (4S,4aS,5aR,12aS)-4-[chloro(methyl)amino]-3,10,12,12a-tetrahydroxy-11-methylidene-1-oxo-3,4,4a,5,5a,6-hexahydro-2H-tetracene-2-carbonitrile

InChI

InChI=1S/C21H21ClN2O5/c1-9-15-10(4-3-5-14(15)25)6-11-7-13-17(24(2)22)18(26)12(8-23)19(27)21(13,29)20(28)16(9)11/h3-5,11-13,17-18,25-26,28-29H,1,6-7H2,2H3/t11-,12?,13-,17-,18?,21+/m0/s1

InChI Key

YSRCRYHWIYXAOI-QDVNLPEDSA-N

Canonical SMILES

CN(C1C2CC3CC4=C(C(=C)C3=C(C2(C(=O)C(C1O)C#N)O)O)C(=CC=C4)O)Cl

别名

• SCHEMBL12575382