ID: 27301
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1=C2CC(C)CC1=O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.608
InChIKey:VEDAVHKTDOSRAU-UHFFFAOYSA-N
ID: 27302
SMILES:O(C(=O)CC1OC2C3(C1c1c(cc(CCCCC)cc1O)O3)OC2)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.395
CB1 binding score: -15.398
InChIKey:ALUXLXDTCNMEPI-UHFFFAOYSA-N
ID: 27303
SMILES:C1=C(C)C=CC2C(C)(C)Oc3cc(C)cc(O)c3C2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.372
CB1 binding score: -16.839
InChIKey:UOHKTFUENICCPG-UHFFFAOYSA-N
ID: 27304
SMILES:OC12c3c(cc(CCCCC)cc3O1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -14.387
InChIKey:GLJBRQHDORVRCR-UHFFFAOYSA-N
ID: 27305
SMILES:C(c1cc(-c2cc3c(c(O)c2)C(C)OC(=O)C3)c(O)c2c1OC(C)(C)C1C2C=C(C)CC1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 488.624
CB1 binding score: -15.504
InChIKey:ISTCXTZWQKVKJY-UHFFFAOYSA-N
ID: 27306
SMILES:c1(OC)c2c(cc(CCCCC)c1)OC(C)(C)C1=C2C(O)=C(C)C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -17.131
InChIKey:ZSIGAKWAGJVPIF-UHFFFAOYSA-N
ID: 27307
SMILES:C(c1cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1)CCc1ccccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.529
CB1 binding score: -15.682
InChIKey:NWHNKTJXANNXRE-UHFFFAOYSA-N
ID: 27308
SMILES:Oc1cc(O)c2c(c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.766
InChIKey:GNBSKWGIRCMMKP-UHFFFAOYSA-N
ID: 27309
SMILES:C(C1CCC(C)=CC1c1c(O)ccc(C(CC(C)C)=O)c1O)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.148
InChIKey:FMDHTHHMPFEXBH-UHFFFAOYSA-N
ID: 27310
SMILES:C1C(C)=C2c3c(cc(CCCCC)cc3O)OC(C)(CCC=C(C)C)C2C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -12.376
InChIKey:BFRNBEUSFFQANU-UHFFFAOYSA-N
ID: 27311
SMILES:C(CCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)C1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.186
InChIKey:KQQMZTULVOWZJR-UHFFFAOYSA-N
ID: 27312
SMILES:C1=CC(C)(C)Oc2cc(CCCCC)c(C(OC)=O)c(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -17.656
InChIKey:RMVSYXDQHUTNPJ-UHFFFAOYSA-N
ID: 27313
SMILES:C(CCCCC)c1cc(O)c2c(c1)C(=O)C(CC=C(CCC=C(C)C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -17.818
InChIKey:UVZYRKPBBFSNJU-UHFFFAOYSA-N
ID: 27314
SMILES:c1(C(=N)O)cc2c(cc1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 271.36
CB1 binding score: -16.576
InChIKey:FQTUKGBQQWZAAA-UHFFFAOYSA-N
ID: 27315
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1c2c(O)ccc1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.546
InChIKey:GHASULVAOGUFNM-UHFFFAOYSA-N
ID: 27316
SMILES:c1c(C=O)oc(=O)c(CC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2)c1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.471
CB1 binding score: -15.82
InChIKey:NBJGVHDOVFDVHX-UHFFFAOYSA-N
ID: 27317
SMILES:C1(C)CCC2c3c(cc(CCCCC)cc3O)OC=C2C1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -15.519
InChIKey:MESNFUMLPGJLFH-UHFFFAOYSA-N
ID: 27318
SMILES:O=C1C(=C)C(C)C(c2c(O)cc(CCCCC)cc2)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -14.462
InChIKey:COOCNNCTZSLMDI-UHFFFAOYSA-N
ID: 27319
SMILES:c1c(CCCCC)c(OC)c2c3c1OC(C)(C)C2CCC(C)=C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.365
InChIKey:YIHHZYAWIQIHKA-UHFFFAOYSA-N
ID: 27320
SMILES:CCCCCc1cc2c(c(O)c1)C1C(C1(C)C)CC(C)C1=C2C(=O)C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -14.284
InChIKey:USZGLZVREPVLEY-UHFFFAOYSA-N
ID: 27321
SMILES:c12c(cc(CCCCC)cc1O)OC1(C(C)C)C(=O)C3C(C)=CC4C(C3(C)C2=C1)CC(=C(C)C)C(=O)C4
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 502.695
CB1 binding score: -15.413
InChIKey:UCQAQOYJLNWWMA-UHFFFAOYSA-N