ID: 94585
SMILES:CC1=CCC2C(C1)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 94586
SMILES:CC1=CC(c2c(O)cc(CCCCC)c(O)c2)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.048
InChIKey:FUZJMTMPVZRGQF-UHFFFAOYSA-N
ID: 94587
SMILES:C12C(C)(CO)C(O)CCC1(C)Oc1c(c(O)cc(CCCCC)c1)C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.482
CB1 binding score: -13.721
InChIKey:IANBROLTUIFMRB-UHFFFAOYSA-N
ID: 94588
SMILES:C12(C)C3OC3(C)C3C(c4c(O)cc(C)cc4OC3OC1)C2CC(OC)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.406
CB1 binding score: -14.598
InChIKey:SEYIQHITPMCMPL-UHFFFAOYSA-N
ID: 94589
SMILES:c1c(C)cc2c(c1)C(C)(C)Oc1c-2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 94590
SMILES:C1(OC(C)(C)C2CC3C(C)(Oc4c(c(OC)cc(CCCCC)c4)C3)CC2)CC=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.695
CB1 binding score: -14.858
InChIKey:OWTZZMVMGYRNIA-UHFFFAOYSA-N
ID: 94591
SMILES:CC1(O)CCC2C(C)(C)Oc3cc(CCCCC)c(C(OC(C)=O)C(=O)O)c(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.556
CB1 binding score: -13.888
InChIKey:MWJZICFAAUHUFH-UHFFFAOYSA-N
ID: 94592
SMILES:C12C(C)(CC(O)C3C(C)(C)CCCC13C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -16.792
InChIKey:MZDRLEGIJITYRA-UHFFFAOYSA-N
ID: 94593
SMILES:C(CC=O)(C)=CCCC(C)=CCc1c(O)cc(CCCCC)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 358.522
CB1 binding score: -15.622
InChIKey:AMPFKYTYZVIGJS-UHFFFAOYSA-N
ID: 94594
SMILES:CC(C12Oc3c(c(O)c(CC=C(C)CCC=C(C)C)c(CCCCC)c3O)C(C1)C2C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.667
CB1 binding score: -15.929
InChIKey:JLFCFTURVHMWCW-UHFFFAOYSA-N
ID: 94595
SMILES:Oc1c(CCC)c(CC=C(C)CCC=C(C)C)c(OC(C)=O)cc1C(O)C(O)C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -12.036
InChIKey:PRZONFTXUYFGOJ-UHFFFAOYSA-N
ID: 94596
SMILES:C12c3c(O)cc(CCCCC)cc3OC(C1(C)C)CC1(C)CCC(C(C)=C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -15.12
InChIKey:CZPLKRXIJOHAHV-UHFFFAOYSA-N
ID: 94597
SMILES:O1c2cc(CCCCC)cc(O)c2C2C(O)C1(C)CCCC(C)(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -14.79
InChIKey:VMFUSPGJDLMMTD-UHFFFAOYSA-N
ID: 94598
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(C)C)(CC2=O)C(O)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -16.716
InChIKey:JPJKQAMYMMPOAJ-UHFFFAOYSA-N
ID: 94599
SMILES:CC1=CC(c2c(OC)ccc(CCN(C)C)c2)C(C(=C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.485
CB1 binding score: -18.294
InChIKey:GJDVDGGMUGCJGX-UHFFFAOYSA-N
ID: 94600
SMILES:C(C)CCCc1c(C(=O)O)c(O)c(CC=C(C)C)c(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -19.394
InChIKey:IQDBYPKRWVDTCI-UHFFFAOYSA-N
ID: 94601
SMILES:CCCCCc1cc2c(c(O)c1)C1C(C(O)(C)C)CCC(C)(CC1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.499
InChIKey:XREAGBGXAPWDDD-UHFFFAOYSA-N
ID: 94602
SMILES:c1(O)cc(C)cc(O)c1C1C=C(C)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.979
InChIKey:GKVOVXWEBSQJPA-UHFFFAOYSA-N
ID: 94603
SMILES:c12cc(CCCCC)cc(O)c1C1C(CC(C)(C)O2)C=C(C)C(=O)C1(O)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -15.944
InChIKey:BRLLACIFHPIVBQ-UHFFFAOYSA-N
ID: 94604
SMILES:C1C(CCC=C(C)C)=CC(c2c(O)cccc2)CC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.443
CB1 binding score: -14.733
InChIKey:TXIOMWWMBYRIQU-UHFFFAOYSA-N
ID: 94605
SMILES:C12=C(CC(C(C)=C)CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -15.472
InChIKey:RRLXZHXLFWCYOU-UHFFFAOYSA-N