ID: 125224
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1c2c(OC2C(O)C(O)C(O)C(CO)O2)ccc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.474
CB1 binding score: -12.702
InChIKey:OLPJRISGDZOLJN-UHFFFAOYSA-N
ID: 125225
SMILES:Oc1c(C(=O)CCC(OC)=O)cc2c(c1)OC(C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.433
CB1 binding score: -14.818
InChIKey:BBHNQIANLGHIGI-UHFFFAOYSA-N
ID: 125226
SMILES:C12c3c(O)cc(CCCCC)cc3OC(C)(C)C1CC(=O)C(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.026
InChIKey:FJVJQPVMJALOMF-UHFFFAOYSA-N
ID: 125227
SMILES:C=C(C1CCC(C)(O)C1Cc1c(OC(=O)C)cc(CCCCC)cc1OC(C)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -15.288
InChIKey:VIICBJBQIOTYIA-UHFFFAOYSA-N
ID: 125228
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(C(C)C)(CCC3(C)OC3C1)C(=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -15.464
InChIKey:XGWIGWNSJUCPIR-UHFFFAOYSA-N
ID: 125229
SMILES:COc1c(CC=C(CCC=C(C)C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.49
InChIKey:KASVLYINZPAMNS-UHFFFAOYSA-N
ID: 125230
SMILES:C1CC2C(C3C(C)(C)Oc4cc(CCCCC)cc(O)c43)C=C(O)C1=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -15.929
InChIKey:BUULYNPJYJXQRV-UHFFFAOYSA-N
ID: 125231
SMILES:OC(C)(CCC=C(C)C)C1Oc2cc(CCCCC)cc(O)c2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.732
InChIKey:KEABNGNNOKLMEH-UHFFFAOYSA-N
ID: 125232
SMILES:CC1=Cc2c(c(O)cc(CCCCC)c2)C2=CC(C)(C)OC(=O)C2=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.447
CB1 binding score: -15.374
InChIKey:GPRIYMIEPARQMQ-UHFFFAOYSA-N
ID: 125233
SMILES:CC(=CC1C(=O)C(O)=C(C)C(=O)c2c1c(O)cc(CCCCC)c2C=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.527
CB1 binding score: -14.341
InChIKey:MKIPYKCEUSQOBS-UHFFFAOYSA-N
ID: 125234
SMILES:C(CCC1(C)C(O)Cc2c(O)cc(C)cc2O1)C(C(=C)C)OO
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.401
CB1 binding score: -16.598
InChIKey:WQYRJMLJDSABSG-UHFFFAOYSA-N
ID: 125235
SMILES:c1([N+](O)=O)ccc(NN=C2C(C)(C)C3(CC=C(C)C)CC(Br)C(C)(C)OC3=C2C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 491.45
CB1 binding score: -15.405
InChIKey:FQKVEXMDCWFVKE-UHFFFAOYSA-N
ID: 125236
SMILES:C1=C(C)CCC(O)C(C)(C)Oc2cc(CCCCC)cc(O)c2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.809
InChIKey:ZLVXPWJJYLDVIH-UHFFFAOYSA-N
ID: 125237
SMILES:C1C2C(C(C)(C)Oc3cc(CCCCCCC)cc(O)c32)C(OC)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -17.127
InChIKey:QFTJEGWJTNHSFE-UHFFFAOYSA-N
ID: 125238
SMILES:O=C(C12C(CCC3(C)Oc4cc(CCCCC)cc(O)c4C13)C(C)(C)OC2)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -12.312
InChIKey:BEKFAJDCZPINNX-UHFFFAOYSA-N
ID: 125239
SMILES:Oc1cc2c(cc1CCCCC)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.716
InChIKey:MMMBBXWSLJXQAV-UHFFFAOYSA-N
ID: 125240
SMILES:c12ccc(CCCC)cc1C1(C3=CCC(=C(C)C)CC3C(C)(CCC=C(C)C)C2)OC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.648
CB1 binding score: -14.853
InChIKey:TVHMUOFVLWWGGE-UHFFFAOYSA-N
ID: 125241
SMILES:c1(CC(C)C)cc(C=O)c(O)c2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -14.041
InChIKey:ATLJEDNVUGPZRE-UHFFFAOYSA-N
ID: 125242
SMILES:c12c(c(O)cc(CCCCC)c1)C1=CC(C)(O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.296
InChIKey:FZAGTOJLWTUWJG-UHFFFAOYSA-N
ID: 125243
SMILES:C(C)(CO)(C1C=C(C)CC2c3c(OC)cc(CCCCC)cc3OC(C)(C)C2C1=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -17.728
InChIKey:RNPHVXZVXFYXBC-UHFFFAOYSA-N
ID: 125244
SMILES:C1(C(=C)C)C(c2c(O)cc(CCC)cc2OC)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.854
InChIKey:OZYYEDPTJXVZJQ-UHFFFAOYSA-N