ID: 108844
SMILES:C(Oc1cc(CCCCC)cc2c1C1CC(C)(C)CC1C(C)=CC2=O)(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -16.719
InChIKey:SZMAZJMRKWJXBH-UHFFFAOYSA-N
ID: 108845
SMILES:c1(O)cc(CCCCC)nc2c1C1CC(C(C)=C)CCC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 315.457
CB1 binding score: -14.295
InChIKey:PWXJLVMBKNHEQM-UHFFFAOYSA-N
ID: 108846
SMILES:CC(=CCc1c(O)cc(CC=C(C)CCC=C(C)C)c(O)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.051
InChIKey:TXLIVWXFPYVBTA-UHFFFAOYSA-N
ID: 108847
SMILES:C1Oc2c(c(O)cc(CCCCC)c2)C1(C)CCC=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -15.411
InChIKey:JUVPVGZDRIKNRH-UHFFFAOYSA-N
ID: 108848
SMILES:C1CC(C)=CC(c2c(O)cc(CCC(=O)OCC)cc2O)C1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.833
InChIKey:MLIYFAFXRBFSIT-UHFFFAOYSA-N
ID: 108849
SMILES:C(C)(O)(C)CCC1C(c2c(O)cc(CCCCC)cc2O)C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.537
CB1 binding score: -12.695
InChIKey:OGVYIDBGRYKXKJ-UHFFFAOYSA-N
ID: 108850
SMILES:C12c3c(O)cc(C)cc3OC(C)(C)C1CCC(C)(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -18.006
InChIKey:SUFPQJMELBBUPW-UHFFFAOYSA-N
ID: 108851
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1C1C(=C)CCC1C(C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -15.929
InChIKey:DFZLEQLMFVMMQO-UHFFFAOYSA-N
ID: 108852
SMILES:C1(c2c(O)cc(CCCCC)cc2OC)C2C(C)(C)C(C)(CC2)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.739
InChIKey:IKSAUGILXXPLHT-UHFFFAOYSA-N
ID: 108853
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 108854
SMILES:c1(O)c2c(cc(C)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 108855
SMILES:CC1=CCCC(C)=CC(=O)c2c(OC)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.244
InChIKey:RKSSGYHBBSZEGY-UHFFFAOYSA-N
ID: 108856
SMILES:C1C(OC2OC(CO)C(O)C(O)C2O)C(C)=CC2c3c(OC)cc(CCCCC)cc3OC(C)(C)C12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.636
CB1 binding score: -15.929
InChIKey:DYDQVROAZDLFFG-UHFFFAOYSA-N
ID: 108857
SMILES:c1(C)c2c(cc(O)c1CCCCCCCCCCCC)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.685
CB1 binding score: -15.113
InChIKey:NHRLLCJTEZDQHG-UHFFFAOYSA-N
ID: 108858
SMILES:Oc1c(C2C=C(C)CCC2C(C)=C)c(O)ccc1C=CCO
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -16.581
InChIKey:DRNCJVGGZWNFRH-UHFFFAOYSA-N
ID: 108859
SMILES:C1=C(C(OC)=O)C(CC2(C)C=Cc3c(cc(C)c(C(=O)CC(CC)C)c3)O2)CC(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.58
CB1 binding score: -14.954
InChIKey:DRJLGFSWTDRUMX-UHFFFAOYSA-N
ID: 108860
SMILES:C1=CC2(C)c3c(cc(CCCC(C)CCCCCC)cc3OC)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.631
CB1 binding score: -11.046
InChIKey:XNTHQOKDTFRFAZ-UHFFFAOYSA-N
ID: 108861
SMILES:C(C)C(c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)C(=O)C1)c1ccc(Br)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 457.408
CB1 binding score: -16.249
InChIKey:QCIOGUSNMWRHFM-UHFFFAOYSA-N
ID: 108862
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 108863
SMILES:CC1(C)Oc2cc(C)cc(O)c2C2C=C(COC(=O)CC(C)C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.445
InChIKey:CNKXZDVUFWMDDT-UHFFFAOYSA-N
ID: 108864
SMILES:C1(=O)CC(C(C)C)C2c3c(O)cc(CCCCC)cc3OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.763
InChIKey:XHNUPPNLMUXJAY-UHFFFAOYSA-N