Name: (7S,9Z,11S,12R,13S,14R,15R,16R,17S,18S,19Z,21Z)-2,15,17,27,29-pentahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-26-[(E)-{[4-methyl(2,2,3,3,5,5,6,6-2H8)piperazin-1-yl]imino}methyl]-6,23-dioxo-8,30-dioxa-24-azatetracyclo[23.3.1.1^{4,7}.0^{5,28}]triaconta-1,3,5(28),9,19,21,25(29),26-octaen-13-yl acetate
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sdf 文件

结构编辑

类似物检索

HIT ID:HIT218849475
Cas No:
常用名:(7S,9Z,11S,12R,13S,14R,15R,16R,17S,18S,19Z,21Z)-2,15,17,27,29-pentahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-26-[(E)-{[4-methyl(2,2,3,3,5,5,6,6-2H8)piperazin-1-yl]imino}methyl]-6,23-dioxo-8,30-dioxa-24-azatetracyclo[23.3.1.1^{4,7}.0^{5,28}]triaconta-1,3,5(28),9,19,21,25(29),26-octaen-13-yl acetate
常用名:(7S,9Z,11S,12R,13S,14R,15R,16R,17S,18S,19Z,21Z)-2,15,17,27,29-pentahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-26-[(E)-{[4-methyl(2,2,3,3,5,5,6,6-2H8)piperazin-1-yl]imino}methyl]-6,23-dioxo-8,30-dioxa-24-azatetracyclo[23.3.1.1^{4,7}.0^{5,28}]triaconta-1,3,5(28),9,19,21,25(29),26-octaen-13-yl acetate
IUPAC:(7S,9Z,11S,12R,13S,14R,15R,16R,17S,18S,19Z,21Z)-2,15,17,27,29-pentahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-26-[(E)-{[4-methyl(2,2,3,3,5,5,6,6-2H8)piperazin-1-yl]imino}methyl]-6,23-dioxo-8,30-dioxa-24-azatetracyclo[23.3.1.1^{4,7}.0^{5,28}]triaconta-1,3,5(28),9,19,21,25(29),26-octaen-13-yl acetate
IUPAC:(7S,9Z,11S,12R,13S,14R,15R,16R,17S,18S,19Z,21Z)-2,15,17,27,29-pentahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethyl-26-[(E)-{[4-methyl(2,2,3,3,5,5,6,6-2H8)piperazin-1-yl]imino}methyl]-6,23-dioxo-8,30-dioxa-24-azatetracyclo[23.3.1.1^{4,7}.0^{5,28}]triaconta-1,3,5(28),9,19,21,25(29),26-octaen-13-yl acetate
InChI key:JQXXHWHPUNPDRT-OMPAHXSPSA-N

分子式:C43H58N4O12
分子量:831.002
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[2H]C1([2H])N(C)C([2H])([2H])C([2H])([2H])N(\N=C\c2c(O)c3c4C(=O)[C@]5(C)Oc4c(C)c(O)c3c(O)c2NC(=O)\C(C)=C/C=C\[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(C)=O)[C@H](C)[C@@H](OC)\C=C/O5)C1([2H])[2H]
SMILES:[2H]C1([2H])N(C)C([2H])([2H])C([2H])([2H])N(\N=C\c2c(O)c3c4C(=O)[C@]5(C)Oc4c(C)c(O)c3c(O)c2NC(=O)\C(C)=C/C=C\[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(C)=O)[C@H](C)[C@@H](OC)\C=C/O5)C1([2H])[2H]

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