ID: 97567
SMILES:Oc1cc(CCCC)cc2c1C1C(C(=C)C)CCC(=C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.454
CB1 binding score: -17.012
InChIKey:CFMFJNULZOFBHI-UHFFFAOYSA-N
ID: 97568
SMILES:C(CC)CCc1cc(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: 97569
SMILES:C(=O)C1=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)c(C(=O)O)cc12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -15.358
InChIKey:AKBDORCYVYQNEL-UHFFFAOYSA-N
ID: 97570
SMILES:C(CCC)CCCc1cc2c(c(O)c1)C1C(C(C)C)CCC(O)(C)C2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -15.721
InChIKey:QTNVOWDKDCVMQR-UHFFFAOYSA-N
ID: 97571
SMILES:c1(CCCC)cc2c(c(O)c1)C1CC(C)(O2)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -17.933
InChIKey:YXFGNPXVGYLXKP-UHFFFAOYSA-N
ID: 97572
SMILES:C(CCCC)c1cc2c(c(O)c1C1C=C(C)CCC1C(=C)C)OC1(C(=O)C(O)(C(=O)C(C)C)C2=O)OC(C)(C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 582.734
CB1 binding score: -13.593
InChIKey:ZENAARXQHJLIRU-UHFFFAOYSA-N
ID: 97573
SMILES:CC=C(C(c1c(O)c2c(cc1CO)OC(C)(C)C1C2C(O)C(C)(O)CC1)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -14.391
InChIKey:UWSMBBFIXMGVIH-UHFFFAOYSA-N
ID: 97574
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C(CC=C(C)C1)C1(C)CCC(C(C)(O)C)OC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.641
CB1 binding score: -16.659
InChIKey:UGOIHMHBTHSEAD-UHFFFAOYSA-N
ID: 97575
SMILES:c1(O)c2c(c(C(=O)C=COC(=O)C)cc1C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.445
CB1 binding score: -15.592
InChIKey:JRMJOVKTBVUYDE-UHFFFAOYSA-N
ID: 97576
SMILES:C1C(C(C)C)C(c2cc(CCCCCCC)ccc2)CC(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.557
CB1 binding score: -15.588
InChIKey:DECRHGHRFPEUHD-UHFFFAOYSA-N
ID: 97577
SMILES:CC(C)(O)C1CCC2(C)C3C(C)(CCC21)Oc1cc(CCCCC)c(C(O)=O)c(O)c1O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.584
CB1 binding score: -14.953
InChIKey:KXKABLFQESKOHX-UHFFFAOYSA-N
ID: 97578
SMILES:C1C(C(C)(C)[N+]#[C-])CC2C(C)(C1)Oc1c(c(OC)cc(CCCCC)c1)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 369.549
CB1 binding score: -15.116
InChIKey:YWXPBZOKZRFZHS-UHFFFAOYSA-N
ID: 97579
SMILES:C(Oc1c2c(cc(CCCC)c1)OC(C)(C)C1CCC(C)(O)CC12)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -12.999
InChIKey:KXUBIZKULMNYKG-UHFFFAOYSA-N
ID: 97580
SMILES:CC(O)(C)C1Oc2c(cc(CCCCC)cc2O)C(O)C2C1C(O)CC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -16.118
InChIKey:PWCWJSRLJUCXBL-UHFFFAOYSA-N
ID: 97581
SMILES:C1C(OC=O)(C)CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.943
InChIKey:QCCMVDMRURYOHQ-UHFFFAOYSA-N
ID: 97582
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(C)(C)O2)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -19.296
InChIKey:GEMPDHCIWOATES-UHFFFAOYSA-N
ID: 97583
SMILES:c1(O)c2c(cc(CCCC)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.175
InChIKey:RVWTXSLOGRTPEH-UHFFFAOYSA-N
ID: 97584
SMILES:c12c(cc(CCCC)cc1O)OC(C)(C)c1ccc(C)cc1-2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.41
CB1 binding score: -19.327
InChIKey:GGVVJZIANMUEJO-UHFFFAOYSA-N
ID: 97585
SMILES:c1(C)c2c(cc(O)c1)CCC1C(C)(C)OC(=O)C=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -14.599
InChIKey:MXQULQXLOKLKFT-UHFFFAOYSA-N
ID: 97586
SMILES:C1(C)=CCC2C(C1)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 97587
SMILES:CCCCCc1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N