ID: 14092
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1C2C=C(C(=O)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 14093
SMILES:CC1(C)C(O)CC(=O)C2(C)c3c(c(=O)cc(CCCCC)cc3O)OCC12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -16.327
InChIKey:ICTMRCQIKJKGOK-UHFFFAOYSA-N
ID: 14094
SMILES:C(CCCc1cc2c(c(O)c1)C1C=C(C(=O)OC)CCC1C(=C)CO2)C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -14.041
InChIKey:KAWSBUHQEVDZBS-UHFFFAOYSA-N
ID: 14095
SMILES:C1=C(C)CC2C(C1=O)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.035
InChIKey:KEAXRVVDSBXMMT-UHFFFAOYSA-N
ID: 14096
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(C)(C)O2)CCO1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -17.509
InChIKey:IVVMRLBJADNCTJ-UHFFFAOYSA-N
ID: 14097
SMILES:O=C(C)c1cc(CCCCC)cc2c1OC(C)(C)C1=CCC(C)C1C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -16.593
InChIKey:LSRTVKDQDBGQPR-UHFFFAOYSA-N
ID: 14098
SMILES:C1(Cc2c(O)cc(CCCCC)cc2O)C(C)(C)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -16.968
InChIKey:CKKNQYUUWIRDPZ-UHFFFAOYSA-N
ID: 14099
SMILES:C1CC2C(C=C1C)c1c(O)cc(CCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 14100
SMILES:C1(C)(C)Oc2c(c(O)cc(CCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 14101
SMILES:CC1CCC(C(C)=C)C1c1c(OCc2ccccc2)cc(CCCCC)c(C(=O)O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.592
CB1 binding score: -13.272
InChIKey:AOBSERORNCBZQW-UHFFFAOYSA-N
ID: 14102
SMILES:CC1OC2c3c(O)c(Br)c(C)cc3OC(C)(C)C1CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 369.299
CB1 binding score: -12.508
InChIKey:RDRDZAUEQRPLNM-UHFFFAOYSA-N
ID: 14103
SMILES:C(c1c2c(c(C)cc1O)C(C)CC(C(C)(O)C)O2)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.419
CB1 binding score: -17.012
InChIKey:SAADNIJFIKNNLA-UHFFFAOYSA-N
ID: 14104
SMILES:CC1(Cc2c(OC(=O)C)cc(CCCCC)cc2O)C(C)=CCCC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.913
InChIKey:AOKQDYLTGZJLEG-UHFFFAOYSA-N
ID: 14105
SMILES:C1(C)=CC2C(C(O)C1)C(C)(C)Oc1cc(C)c(O)cc12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 274.36
CB1 binding score: -16.698
InChIKey:IWDTYONXAWFHQB-UHFFFAOYSA-N
ID: 14106
SMILES:C1(O)CC(C)=CCCC(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -14.612
InChIKey:FLHYLICHPFMGRY-UHFFFAOYSA-N
ID: 14107
SMILES:C1C2C(C)(C)Oc3cc(CCCC)c(Br)c(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 325.246
CB1 binding score: -14.364
InChIKey:KZAISVSPRFOXQQ-UHFFFAOYSA-N
ID: 14108
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.729
InChIKey:GIIVGKMZIUKMMN-UHFFFAOYSA-N
ID: 14109
SMILES:C(CCCc1cc2c(c(O)c1)C1CC(=C)C(CC=C1C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -16.136
InChIKey:QLQJZKRTJLUWCW-UHFFFAOYSA-N
ID: 14110
SMILES:C(CC(C(C)C)c1c(Cc2c(C(=O)OC)c(CCCCC)cc(OC(C)=O)c2C)OC(C)(C)CC1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 514.747
CB1 binding score: -16.042
InChIKey:OSBJLKSOZBCZIB-UHFFFAOYSA-N
ID: 14111
SMILES:C1(=O)C(C)(C)C(=O)C2(C)C1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -15.766
InChIKey:WCWVHUNVCBBFJA-UHFFFAOYSA-N
ID: 14112
SMILES:C(Cc1c(CCCCC)cc(O)c2c1OC1C2C(C)(C)CC2CC21C)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -18.331
InChIKey:GJZSSCSDKRTCTN-UHFFFAOYSA-N