ID: 114892
SMILES:C(CCc1cc(O)c2c(c1)OC1(C)C(C(C)(C)CCC1)CC2=O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.72
InChIKey:ROHVUCFVQSBVLG-UHFFFAOYSA-N
ID: 114893
SMILES:C1(=O)CC(C)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.916
InChIKey:DVZWHCDOMLHKEM-UHFFFAOYSA-N
ID: 114894
SMILES:C12C(CC(C)=CC1)c1c(O)c(OC)ccc1OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.665
InChIKey:KKYQBIKHYRQVHJ-UHFFFAOYSA-N
ID: 114895
SMILES:C(C(O)C(C)=C)CC1(C)Oc2cc(CCC)cc(O)c2C=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.156
InChIKey:GGAYJOHZHSNUNN-UHFFFAOYSA-N
ID: 114896
SMILES:C1C(C(C)(CCCC(C)COc2cc(CCCCC)cc(O)c2)O)OC(C)(C)C1CCC(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.698
CB1 binding score: -16.278
InChIKey:YFBXHHVGFKJQLB-UHFFFAOYSA-N
ID: 114897
SMILES:C1(C)(O)CCc2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 250.338
CB1 binding score: -17.974
InChIKey:UWCDDQGADQVJPN-UHFFFAOYSA-N
ID: 114898
SMILES:C1CC(C(C)=C)C(c2c(O)cc(CCC)cc2O)C1C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -17.038
InChIKey:BWQMCESKJAJBFU-UHFFFAOYSA-N
ID: 114899
SMILES:C1(C)(C)Oc2c(c(OC(C)(C)C)ccc2CCCCC)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.474
CB1 binding score: -13.542
InChIKey:KUHXLZORRKLPRI-UHFFFAOYSA-N
ID: 114900
SMILES:C12(C(O)CC(C)O1)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -12.585
InChIKey:YAOXTCTZOKSMHL-UHFFFAOYSA-N
ID: 114901
SMILES:c1(CCN)cc(O)c2c(c1)OC(C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 237.299
CB1 binding score: -14.71
InChIKey:CDNDVEKMIKIPFQ-UHFFFAOYSA-N
ID: 114902
SMILES:c1(=O)c2c(O)cc(CCCCC)cc2OC(C)(C)C2CCC(C)=C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.912
InChIKey:ICKLEZDNADXJLW-UHFFFAOYSA-N
ID: 114903
SMILES:C(c1cc(CCCC)cc(O)c1)(=O)C1C(C(C)CCC=C(C)C)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -16.095
InChIKey:CHEOGPGSTXGYEF-UHFFFAOYSA-N
ID: 114904
SMILES:Oc1c(C2C(C(C)=C)CC=C(C)CCC=C(C)C2)c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -15.929
InChIKey:CBKAQVHIYZRPLT-UHFFFAOYSA-N
ID: 114905
SMILES:c1(CC(C)C)cc(O)c2c(c1)OC(C)(C)C1C2CC(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -16.239
InChIKey:PMDYIJPFCBJCJI-UHFFFAOYSA-N
ID: 114906
SMILES:C(c1cc(O)c(C2C(C(=C)C)CCC(C)=C2)cc1)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 256.345
CB1 binding score: -18.089
InChIKey:NDGQQJSQRFKRAW-UHFFFAOYSA-N
ID: 114907
SMILES:C1(=O)C2=C(c3c(cc(CCCCC)cc3O)OC(C)(C)C2=C)C(=O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.457
CB1 binding score: -14.052
InChIKey:MQUBFMPHNSWQHF-UHFFFAOYSA-N
ID: 114908
SMILES:C12c3c(O)cc(CCCCC)cc3OC(C)(C)C1CCC(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 114909
SMILES:c1(C(C)C)cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -18.72
InChIKey:MRWXCLDGBJQAHZ-UHFFFAOYSA-N
ID: 114910
SMILES:O1c2cc(CCCCC)cc(O)c2CC1(CC=C(C)CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -16.015
InChIKey:ZQNXPLKOJAKYNG-UHFFFAOYSA-N
ID: 114911
SMILES:C12CCC(C)=CC1c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 114912
SMILES:CC(c1ccc(O)c2c1OC(C)(C)C1C2C=C(C)CC1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -17.455
InChIKey:RMNZBBOSEWAEAP-UHFFFAOYSA-N