ID: 94753
SMILES:C(CCc1cc(O)c2c(c1)OC(c1ccccc1)(CC1CC(C)(O)CCC1C(=C)C)C2=O)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.63
CB1 binding score: -16.015
InChIKey:PGCLJNUWBZDODN-UHFFFAOYSA-N
ID: 94754
SMILES:O1C(Cc2c(O)cc(CCCCCO)cc2O)C2C(C)(C)C(C)(C2)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -15.552
InChIKey:FCUZRIUTVFTMOF-UHFFFAOYSA-N
ID: 94755
SMILES:c12c(c(OC)cc(CCCCC)c1)C1C(C(O)(C)C)CCC(C)(C2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -17.678
InChIKey:MTCSUPWTJMZPBS-UHFFFAOYSA-N
ID: 94756
SMILES:c1(C2OC(O)C(C)=CCCC(C=O)=CC=C2)c(O)cc(CCCCC)cc1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -14.028
InChIKey:DJIJNIQEHMHCAX-UHFFFAOYSA-N
ID: 94757
SMILES:C(C=Cc1c(CCCCC)cc2c(c1O)C=CC(C)(C)O2)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -15.497
InChIKey:YOUWMKIOLUNVHG-UHFFFAOYSA-N
ID: 94758
SMILES:C(CCCCC)Cc1cc2c(c(O)c1)C1CC(C)(CCC1(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -16.387
InChIKey:FHKMLRPQBFHYSB-UHFFFAOYSA-N
ID: 94759
SMILES:c1(O)c2c(c(O)c(C=O)c1O)C1C(CC=C(CO)C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.341
CB1 binding score: -15.81
InChIKey:AOEPWXYZCSXVSW-UHFFFAOYSA-N
ID: 94760
SMILES:C(CCCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -19.71
InChIKey:SFWRRSGOJSILSQ-UHFFFAOYSA-N
ID: 94761
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1=C2CC(C)CC1=O)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -19.137
InChIKey:NOKIVUMUGQYIDQ-UHFFFAOYSA-N
ID: 94762
SMILES:c1c(CCCCC)c(O)cc2c1OC1(C)C(C(C)(CCC=C(C)C)C(O)CC1)C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -15.67
InChIKey:OXNDYHCEFPBVSS-UHFFFAOYSA-N
ID: 94763
SMILES:C1(CC(OC)=O)C(C(=C)C)C(c2cc(CCN(C)C)ccc2OC)C=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 385.548
CB1 binding score: -16.08
InChIKey:DQJXECONRKAEEJ-UHFFFAOYSA-N
ID: 94764
SMILES:C1(C)C=C(O)C(=O)c2cc3c(cc21)-c1c(O)cc(CCCCC)cc1OC3(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.495
CB1 binding score: -14.627
InChIKey:TYDMXJNPNKLDGN-UHFFFAOYSA-N
ID: 94765
SMILES:CC1(C)C(C(=CC(=O)CC(C)=CCc2c(OC)c(OC)cc(O)c2)C)CCC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -13.391
InChIKey:DMMROOQZDPZNPN-UHFFFAOYSA-N
ID: 94766
SMILES:CC1(C)C2=C(C)C(C1O)c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -8.716
InChIKey:GEGNWEVUUYCOBP-UHFFFAOYSA-N
ID: 94767
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2)C(C(C)=C)CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -16.495
InChIKey:VFLHTHNUQQKPQR-UHFFFAOYSA-N
ID: 94768
SMILES:c12c(O)cc(CCCCC)cc1OC(CCC=C(C)C)(C)C(C2)OC=C(C=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.408
InChIKey:NCAKQZCFWFLMDB-UHFFFAOYSA-N
ID: 94769
SMILES:C1CC2C(C)(C)Oc3cc(CCC)c(C(=O)O)c(O)c3C2C1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.748
InChIKey:VPQRJBYFUROIRE-UHFFFAOYSA-N
ID: 94770
SMILES:C1C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 94771
SMILES:CCCCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 94772
SMILES:C(C1Cc2c(c(C(O)=O)c(CCCCC)cc2O)OC1CC1(C)OC1C)(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -14.885
InChIKey:RVBINYXJVWGIED-UHFFFAOYSA-N
ID: 94773
SMILES:C(=O)(Oc1cc(CCCCC)cc2c1-c1c(ccc(C)c1)C(C)(C)O2)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.582
CB1 binding score: -17.348
InChIKey:OXEDAGIVLJZGSG-UHFFFAOYSA-N