ID: 105505
SMILES:O(C(C)(C)C=CCC(C)=CCc1c(O)cc(CCCCC)cc1OC)C(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -15.717
InChIKey:UHZVFKOFJYQVCH-UHFFFAOYSA-N
ID: 105506
SMILES:c1(CC=C(C)CCC(C(=C)C)O)c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -17.188
InChIKey:HBHGDDMOHUGSLN-UHFFFAOYSA-N
ID: 105507
SMILES:C(C1=CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1)([O-])=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 343.443
CB1 binding score: -17.334
InChIKey:OGXXAQFMAFTSRU-UHFFFAOYSA-M
ID: 105508
SMILES:c1(NCC(O)C)c(C2C=C(C)CCC2C(C)=C)cc(O)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 301.43
CB1 binding score: -12.135
InChIKey:CGXRWEAERUCCTE-UHFFFAOYSA-N
ID: 105509
SMILES:c1(C2C(C(=C)C)CCC(C)=C2)c(O)cc(CCCCC)cc1OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -17.989
InChIKey:ZTZGBEZKXBIYDU-UHFFFAOYSA-N
ID: 105510
SMILES:C1(=O)C=CC(C)(C)Oc2c(O)cc(O)c(C3C=C(C)CCC3C(C)=C)c21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.446
CB1 binding score: -15.519
InChIKey:QSZNPEIJBDRYOU-UHFFFAOYSA-N
ID: 105511
SMILES:c1(C)cc(O)c2c(c1C(=O)CCCCCCC(C)C)OC(C)(C)C1C2CC(O)C(C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -16.099
InChIKey:CTPULRGUHHZVAL-UHFFFAOYSA-N
ID: 105512
SMILES:COc1c(C2C(C(C)C)CCC(C)=C2)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -21.398
InChIKey:WPVARKYNWHKQMW-UHFFFAOYSA-N
ID: 105513
SMILES:c1(CC(C)(O)C)c(C2C(C(=C)C)CCC(C)=C2)c2c(c(C(C(CCC)C)=O)c1O)OC(C(C)(C)O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.704
CB1 binding score: -15.091
InChIKey:BACMEWBGTAGNOL-UHFFFAOYSA-N
ID: 105514
SMILES:OC1C(OCc2cc(O)c(C3C=C(C)CCC3C(C)=C)c(O)c2)OC(CO)C(O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.501
CB1 binding score: -17.174
InChIKey:ZIQLPVNSOHKEKN-UHFFFAOYSA-N
ID: 105515
SMILES:C(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.334
InChIKey:KDXXQFACISICHZ-UHFFFAOYSA-N
ID: 105516
SMILES:C1C(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C1OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -17.944
InChIKey:HTPNXIVNXAMVFM-UHFFFAOYSA-N
ID: 105517
SMILES:C(=O)(Oc1cc(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1)C=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -15.929
InChIKey:BDDQHSNCPBRYJC-UHFFFAOYSA-N
ID: 105518
SMILES:c1c(CCCCC)cc2c(c1)OC(C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.54
InChIKey:QBKRMPHNODAHEZ-UHFFFAOYSA-N
ID: 105519
SMILES:C1(C)(C)C2C3(C(C)C(OC)C1)Cc1c(O)cc(CCCCC)cc1OC3(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 400.603
CB1 binding score: -17.099
InChIKey:YUYDGFBMKJCWNQ-UHFFFAOYSA-N
ID: 105520
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1CCC3(C(=O)OC)C(=CC(C)(OO)CC3)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.595
CB1 binding score: -16.635
InChIKey:QRVOWVGDOVJULW-UHFFFAOYSA-N
ID: 105521
SMILES:CC(C)(C1CCC(CO)=CC1c1c(O)cc(OC)cc1CC=C(C)CCC=C(C)C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -14.297
InChIKey:IPQODHSTEPNEBJ-UHFFFAOYSA-N
ID: 105522
SMILES:c1c(C)cc(OC)c2c1OC(CCC=C(C)C)(C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.372
InChIKey:VRVBUCRQGHWYCT-UHFFFAOYSA-N
ID: 105523
SMILES:CC1=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 105524
SMILES:c1(O)c(C2C=C(C)CCC2C(CCC=C(C)C)=C)c(O)c(C(=O)O)c(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -15.365
InChIKey:INRMXWSGYURDAN-UHFFFAOYSA-N
ID: 105525
SMILES:CC1(C)Oc2cc(CCCC(=O)OC)c(C)cc2CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -15.732
InChIKey:RWAIIGCFPZEVJA-UHFFFAOYSA-N