ID: 81607
SMILES:CC(CCC=C(CCC=C(C)C)C)=CCc1c(O)cc(CCc2ccccc2)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.621
CB1 binding score: -19.13
InChIKey:IWSASXREQYAISF-UHFFFAOYSA-N
ID: 81608
SMILES:CCCCCc1ccc2c(c1O)OC1(C)C3CC(C(CCCC(C)(C)O)(C)O1)C3(CBr)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 511.497
CB1 binding score: -15.8
InChIKey:VACPAYRCRHSCMQ-UHFFFAOYSA-N
ID: 81609
SMILES:C(CCC)Cc1cc(O)c(C2C=C(C(C)C)CCC2(O)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.502
InChIKey:SOQPHWVGCZSXEC-UHFFFAOYSA-N
ID: 81610
SMILES:C(C)CCCc1cc(OC(C)=O)c(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -18.767
InChIKey:OGCCABVUOZBTQV-UHFFFAOYSA-N
ID: 81611
SMILES:C1(NCC(C)O)SC2(C)Oc3c(c(O)c(C(=O)OC)c(CCCCC)c3)C(O)C2C(C)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 495.682
CB1 binding score: -15.821
InChIKey:JGJGUAMEGHTQMP-UHFFFAOYSA-N
ID: 81612
SMILES:C(C)CCCc1cc(O)c2c(c1)OC1(C)C3C(C(C)(C)C3)C2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -14.015
InChIKey:KIUGSEITJCUVST-UHFFFAOYSA-N
ID: 81613
SMILES:C(C)(C1=CCC(C)CC1c1c(O)c(C(=O)O)c(CCCCC)cc1O)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.984
InChIKey:DJHBJHKPEIJAAS-UHFFFAOYSA-N
ID: 81614
SMILES:C1C=C(C)C2Cc3c(ccc(O)c3)OC(C)(C)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -17.593
InChIKey:NGCPBWWYWJPVNH-UHFFFAOYSA-N
ID: 81615
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C(=O)O)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.707
InChIKey:OGXXAQFMAFTSRU-UHFFFAOYSA-N
ID: 81616
SMILES:C1C(Oc2cc(CCCCCCCC)ccc2O)C(C)(O)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.565
CB1 binding score: -16.502
InChIKey:AVFZPDZHOWHPTR-UHFFFAOYSA-N
ID: 81617
SMILES:C(OC)(=O)C1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.943
InChIKey:CCMWHLPOQSRJEP-UHFFFAOYSA-N
ID: 81618
SMILES:c1(O)c(C=O)c(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -17.767
InChIKey:NVZOPKWQGYETGZ-UHFFFAOYSA-N
ID: 81619
SMILES:O=C1C(Oc2c(CCCCC)cc(O)c(CC=C(C)C)c2)C2C=C(CO)CCC2C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -15.226
InChIKey:VWEBBXGQFTYNBF-UHFFFAOYSA-N
ID: 81620
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CC=C(C)C3CCC(C)C132
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -15.842
InChIKey:HFYQLLMYAKIGSV-UHFFFAOYSA-N
ID: 81621
SMILES:c1(CCC)cc2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 81622
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 81623
SMILES:C1(C)=CC2c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 81624
SMILES:C(c1ccc2c(c1)C1C=C(C)CCC1C(C)(C)O2)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.416
CB1 binding score: -16.039
InChIKey:QQJYGKLVCUMLKK-UHFFFAOYSA-N
ID: 81625
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1CC(=C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.055
InChIKey:AOYYFUGUUIRBML-UHFFFAOYSA-N
ID: 81626
SMILES:O1c2cc(CCCCC)c(O)c(O)c2C2C(CC=C(C)C)C1(C)CCC2C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -17.123
InChIKey:PTDHSPNADPFIDF-UHFFFAOYSA-N
ID: 81627
SMILES:CC1CCC2c3c(O)cc(C)cc3OC(C)(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -13.978
InChIKey:OFYNTGWILJFNKU-UHFFFAOYSA-N