ID: 117853
SMILES:Oc1cc(CCCC)cc(O)c1C1OC(=O)C=C1C1(C)CCCC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.055
InChIKey:QRHWZSXMGCQBCG-UHFFFAOYSA-N
ID: 117854
SMILES:c12c(c(O)cc(CCC)c1)C(C(CCC=C(C)C)(O)C)CCC(C)(O)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -16.521
InChIKey:NZTAUCRCUCGMKS-UHFFFAOYSA-N
ID: 117855
SMILES:C12(C)OCC1(C)CC(O)C1(C)CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -12.184
InChIKey:ZOPPVUBRWLCNRS-UHFFFAOYSA-N
ID: 117856
SMILES:CC(=CCCC(=CCc1c(O)cc(CCCCC)cc1O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 117857
SMILES:O(c1cc(CCCCC)cc2c1OC1C(C(C(C)(O)C)O2)CCC1C)C1C(O)C(O)OC(CO)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 510.624
CB1 binding score: -14.37
InChIKey:HFHDKOBAYOGSDV-UHFFFAOYSA-N
ID: 117858
SMILES:C(=C)(C)C1CCC(C)=CC1c1c(C)cccc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -18.764
InChIKey:VCTOYXGKNMVKJN-UHFFFAOYSA-N
ID: 117859
SMILES:c1(O)c(CC=C(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -20.5
InChIKey:YVUPWYODRDEDFU-UHFFFAOYSA-N
ID: 117860
SMILES:c1(O)c2c(cc(CCCC)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 117861
SMILES:CC1(C)C2C(CC(C)=CC2)c2c(O)cc(CCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 117862
SMILES:CCCc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 117863
SMILES:c12c(c(O)c(NCC=C(C)C)c(CC=C(C)C)c1O)-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 479.661
CB1 binding score: -12.599
InChIKey:UJGJPKSVENWTQC-UHFFFAOYSA-N
ID: 117864
SMILES:CC1(C)Oc2cc(C)cc(O)c2C2C=C(C(=O)O)CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -17.944
InChIKey:GITSDXGASNCATJ-UHFFFAOYSA-N
ID: 117865
SMILES:COc1cc(CCCCC)cc2c1C1CC(C)=CCCC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.387
InChIKey:LJPPOWZMBHWQQK-UHFFFAOYSA-N
ID: 117866
SMILES:CC(=CCc1c(O)cc(CO)c(Br)c1C1C(C(=C)C)CCC(C)=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 405.376
CB1 binding score: -13.806
InChIKey:YEDFHUUDFFOUPJ-UHFFFAOYSA-N
ID: 117867
SMILES:C(Cc1c(O)c(C2C=C(C)CCC2C(C)=C)c(O)cc1)(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -16.737
InChIKey:KMCLNXHAQWKDOO-UHFFFAOYSA-N
ID: 117868
SMILES:C1C2=C(c3c(O)cc(C)cc3OC2(C)C)CC1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -16.691
InChIKey:MIFGVBFXDBKVID-UHFFFAOYSA-N
ID: 117869
SMILES:CCCCc1c(OC)c(O)c2c(c1)C=CC(C)(CCC1(C)CCCC(C)=C1C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.438
InChIKey:YJILUDQSVUHYAP-UHFFFAOYSA-N
ID: 117870
SMILES:c1(OC)c(CCc2cc(OC)cc(O)c2)cc2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 408.538
CB1 binding score: -15.929
InChIKey:VQHBGVMQDJOZPX-UHFFFAOYSA-N
ID: 117871
SMILES:CCCCCc1cc(O)c2c(c1)OC1(C)CCC(C(C)(C)O)C3C12OC(C)(C)C=C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -15.929
InChIKey:KBHMYBLKMHRCMY-UHFFFAOYSA-N
ID: 117872
SMILES:c1(CC=C(C)CCC(C(=C)C)O)c(O)cc(CCCCC)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.667
InChIKey:DKPAZXCFVUXZQG-UHFFFAOYSA-N
ID: 117873
SMILES:C(=C)(C)C1C(c2cc(CCCCC)cc(OC)c2OC)CC(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -15.294
InChIKey:SLBQCSVCPBPODJ-UHFFFAOYSA-N