ID: 101536
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 101537
SMILES:c1(OC)cc(OC)c(Cl)c2c1C1C(CCC(CO)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.831
CB1 binding score: -17.523
InChIKey:RZQJPJSSMZZGTH-UHFFFAOYSA-N
ID: 101538
SMILES:CC(C1CCC2(C)Oc3cc(CCCCCCCCC)c(C)cc3C2C1)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.62
CB1 binding score: -12.837
InChIKey:ACTZQSLRBDHNMP-UHFFFAOYSA-N
ID: 101539
SMILES:C(OC1C(C)=CC2c3c(cc(CCCCC)cc3OC2(C)C)o1)C(=O)c1ccccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.549
CB1 binding score: -17.873
InChIKey:AKIDQSVCPLWFKJ-UHFFFAOYSA-N
ID: 101540
SMILES:CC1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 101541
SMILES:CC1C2CC(C(C)(N)C)OC(C2)C12Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 359.51
CB1 binding score: -14.648
InChIKey:DLMDWIILFZPADW-UHFFFAOYSA-N
ID: 101542
SMILES:C(CC)CCc1cc2c(c(O)c1)C1C34C(CC=C(C)C1)C(C(C)C)C(OC3=O)C4CCC=C2C(=O)OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.683
CB1 binding score: -12.769
InChIKey:NOMCPGYNHQHMGI-UHFFFAOYSA-N
ID: 101543
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C=C(CCC3C(C)(CCC1C)CCC3C(C)=C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.652
CB1 binding score: -15.096
InChIKey:WOSDGACDVMYHCQ-UHFFFAOYSA-N
ID: 101544
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)CC12)C(=CC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -19.152
InChIKey:QERDFYQCOSZGRF-UHFFFAOYSA-N
ID: 101545
SMILES:c1(C2=CC(=O)C=CC23OC3(C)C)c(OC)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -15.47
InChIKey:DFMWSPVWKXBSNX-UHFFFAOYSA-N
ID: 101546
SMILES:C(CCC(c1c2c(c(C)c(O)c1C=O)OC(C)(C)C1CCC(C)=CC12)O)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -13.034
InChIKey:PEWANIKQOYDVQP-UHFFFAOYSA-N
ID: 101547
SMILES:c1(C2CC(C)C(=O)O2)c(O)cc(CCCCC)cc1OC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -16.43
InChIKey:NHAILESUBKOVBM-UHFFFAOYSA-N
ID: 101548
SMILES:C1(C(CCC=C(C)C)C)c2c(O)cc(CCCCC)cc1OC(C)(C)C(O)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.592
CB1 binding score: -16.092
InChIKey:BPCVZXMFVGMUIB-UHFFFAOYSA-N
ID: 101549
SMILES:C(CCCc1ccc2c(c1)C1C(CCC(C)=C1)C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -19.248
InChIKey:ULSCPFQNHAPIEH-UHFFFAOYSA-N
ID: 101550
SMILES:O1CC2(C(O)=O)C(C1)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.412
CB1 binding score: -14.871
InChIKey:LYIZADNHQCRYAT-UHFFFAOYSA-N
ID: 101551
SMILES:C1(=O)C(C)=C(O)C2(CC(C)(C)CC2C(C)C)c2c1cc(CCCC)cc2OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -15.706
InChIKey:CVGZHNSPHMJOQX-UHFFFAOYSA-N
ID: 101552
SMILES:C1CC(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 101553
SMILES:C12c3c(cc(CCCCC)cc3O)OC1(C)CCC1C(C)(C)CC1C(=C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -18.029
InChIKey:UYPJQCSBXXGNPH-UHFFFAOYSA-N
ID: 101554
SMILES:c1c(O)c(Cl)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.779
CB1 binding score: -16.078
InChIKey:XDTDHTQOAOXORN-UHFFFAOYSA-N
ID: 101555
SMILES:CC(=CCc1c(O)cc(CCCCC)cc1Oc1c(CC=C(C)C)cc(CCC)cc1O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.663
CB1 binding score: -16.197
InChIKey:CACUVHODQBMZHN-UHFFFAOYSA-N
ID: 101556
SMILES:C(c1cc(O)cc(O)c1)CCc1cc(O)c(CC=C(CCC=C(C)C)C)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -15.466
InChIKey:LJXJANFORLFFAT-UHFFFAOYSA-N