ID: 55588
SMILES:CC1(C)Oc2ccc(C(C(O)C)(O)C)cc2C2CCC(C)C(O)C21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -12.66
InChIKey:PCFBBFPTPUGEIM-UHFFFAOYSA-N
ID: 55589
SMILES:CC1(C)C2C(C=C(C)CC2)c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 55590
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 55591
SMILES:c1c(CC=C)c(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -16.376
InChIKey:HBOUEPXBJVNCSM-UHFFFAOYSA-N
ID: 55592
SMILES:C(CCCC)c1ccc2c(c1O)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.141
InChIKey:XFSLHYHFWBPGED-UHFFFAOYSA-N
ID: 55593
SMILES:OCCCC(c1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C=O)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -13.829
InChIKey:QMIXDWVOJFBPSN-UHFFFAOYSA-N
ID: 55594
SMILES:C(CC)CCCc1cc2c(c(O)c1)C1=C(C(=O)C(C)(C)O2)C(C(CCC=C(C)C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.652
CB1 binding score: -14.984
InChIKey:BUOUYJBRCXAZBX-UHFFFAOYSA-N
ID: 55595
SMILES:C12c3c(cc(CCCCC)cc3O)OC(C)(CC(C=C(C)C)=O)C1C(=O)C=C2C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.51
CB1 binding score: -14.939
InChIKey:USTCZAPDFYYVES-UHFFFAOYSA-N
ID: 55596
SMILES:C1CC(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2CCC(C)=CCC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -15.717
InChIKey:YSCBIQJWCJXUSY-UHFFFAOYSA-N
ID: 55597
SMILES:Oc1c(C(=O)C(C)C)c2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -18.957
InChIKey:VIYAGNJWEOQORJ-UHFFFAOYSA-N
ID: 55598
SMILES:C1=C(C)CCC=C(C(O)=O)CCC2C(C)(Oc3c2c(O)cc(CCCCC)c3)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -13.886
InChIKey:SJAPDMREGOTNKL-UHFFFAOYSA-N
ID: 55599
SMILES:c1(CCCCC)cc(O)c2c(c1)C1C(C(C)(C)O2)CC=C(C=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -14.268
InChIKey:NPKCEJQBOJABNO-UHFFFAOYSA-N
ID: 55600
SMILES:c1(C)c(OC(=O)C)c2c(cc1)OC(C)(C)C1CC=C(C)CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -15.724
InChIKey:VMUPPAFDISYBJI-UHFFFAOYSA-N
ID: 55601
SMILES:c12c(cc(CCCCC)cc1O)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: 55602
SMILES:C1(=O)C(C)CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.046
InChIKey:UECUNLJHUBNWSC-UHFFFAOYSA-N
ID: 55603
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)C(O)C21)CCCCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.63
CB1 binding score: -15.985
InChIKey:GODOLBLVPGBPLS-UHFFFAOYSA-N
ID: 55604
SMILES:C12C(C)(C)Oc3cc(CCCC)cc(O)c3C1C=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -15.814
InChIKey:STBLOGJBDMULQL-UHFFFAOYSA-N
ID: 55605
SMILES:C1(c2c(O)cc(CCCCC)cc2O)CC2CCC1C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -16.133
InChIKey:GNENWVCBEDARJP-UHFFFAOYSA-N
ID: 55606
SMILES:C(C1(C)Oc2c(c(O)cc(CCCCC)c2)C=C1)=C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.176
InChIKey:BJNNLQNKXZVKFU-UHFFFAOYSA-N
ID: 55607
SMILES:CCCCCc1cc2c(c(O)c1)c1c(cc2O)OC(C)(C)C(O)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -14.605
InChIKey:UDIKUGDPBVXGHE-UHFFFAOYSA-N
ID: 55608
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)(O)CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N